1-naphthalen-2-yl-N-phenylmethanimine

C17H13N — CID 1225153

IUPAC1-naphthalen-2-yl-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1ccc2ccccc2c1
InChIInChI=1S/C17H13N/c1-2-8-17(9-3-1)18-13-14-10-11-15-6-4-5-7-16(15)12-14/h1-13H/b18-13+
InChIKeyLOWCAGPWRWKNKE-QGOAFFKASA-N
MW231.30 g/mol
LogP4.59
Rot. Bonds2

About 1-naphthalen-2-yl-N-phenylmethanimine

1-naphthalen-2-yl-N-phenylmethanimine (PubChem CID 1225153) has the molecular formula C17H13N and a molecular weight of 231.30 g/mol. Its IUPAC name is 1-naphthalen-2-yl-N-phenylmethanimine.

Molecular Properties

Compound Name1-naphthalen-2-yl-N-phenylmethanimine
PubChem CID1225153
Molecular FormulaC17H13N
Molecular Weight231.30 g/mol
Exact Mass231.10
IUPAC Name1-naphthalen-2-yl-N-phenylmethanimine
SMILESC(=N/c1ccccc1)\c1ccc2ccccc2c1
InChIInChI=1S/C17H13N/c1-2-8-17(9-3-1)18-13-14-10-11-15-6-4-5-7-16(15)12-14/h1-13H/b18-13+
InChIKeyLOWCAGPWRWKNKE-QGOAFFKASA-N
XLogP4.59
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-N-phenylmethanimine?
The IUPAC name of 1-naphthalen-2-yl-N-phenylmethanimine (CID 1225153) is 1-naphthalen-2-yl-N-phenylmethanimine.
What is the SMILES notation for 1-naphthalen-2-yl-N-phenylmethanimine?
The canonical SMILES for 1-naphthalen-2-yl-N-phenylmethanimine is C(=N/c1ccccc1)\c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-N-phenylmethanimine?
The InChIKey is LOWCAGPWRWKNKE-QGOAFFKASA-N. The full InChI is InChI=1S/C17H13N/c1-2-8-17(9-3-1)18-13-14-10-11-15-6-4-5-7-16(15)12-14/h1-13H/b18-13+.
What are the key properties of 1-naphthalen-2-yl-N-phenylmethanimine?
1-naphthalen-2-yl-N-phenylmethanimine has a molecular weight of 231.30 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-N-phenylmethanimine is sourced from PubChem (CID 1225153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).